ASINEX-ZINC04944398 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.0990 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5460 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -1.9280 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -2.6690 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -2.0280 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -2.7560 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8710 0.2570 0.0500 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6310 1.3200 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6750 -0.0880 1.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2640 -1.4670 1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3660 -2.1730 2.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6810 -1.9250 -0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5580 -1.1450 -1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6860 -0.0690 -1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5750 0.7060 -2.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8150 1.6610 -2.3690 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3250 0.3770 -3.4030 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2630 0.9010 -4.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1680 -0.6910 -3.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2770 -1.4230 -2.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1390 -1.1010 -4.7570 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.0270 -2.5430 -4.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9450 -3.0800 -5.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4900 -4.0390 -6.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3320 -4.5310 -7.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6290 -4.0640 -7.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0850 -3.1040 -6.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2440 -2.6160 -5.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1790 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6090 -2.4290 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -3.7480 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -2.9750 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0190 -0.0590 2.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4780 0.6380 1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0700 -2.8110 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3110 -3.3140 -3.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6140 -2.2530 -3.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4760 -4.4050 -5.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9760 -5.2810 -7.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2870 -4.4480 -7.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0980 -2.7390 -6.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6010 -1.8690 -4.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 44 1 0 0 0 0 28 29 1 0 0 0 0 28 45 1 0 0 0 0 29 30 2 0 0 0 0 29 46 1 0 0 0 0 30 31 1 0 0 0 0 30 47 1 0 0 0 0 31 48 1 0 0 0 0 M END